Using VASP

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pseudohydrogen having nuclear charges of +4/3 and +2/3

Last post by support_vasp « Thu Sep 12, 2024 8:03 am
Replies: 1
by cvz5048 » Thu May 30, 2013 6:47 pm

1 Replies

1500 Views

Last post by support_vasp
Thu Sep 12, 2024 8:03 am
BLYP functional

Last post by support_vasp « Thu Sep 12, 2024 8:03 am
Replies: 1
by plumy » Sat Dec 21, 2013 7:05 am

1 Replies

1215 Views

Last post by support_vasp
Thu Sep 12, 2024 8:03 am
Elastic constant calculations

Last post by support_vasp « Thu Sep 12, 2024 8:03 am
Replies: 1
by tanmoy » Mon Nov 18, 2013 1:12 am

1 Replies

1404 Views

Last post by support_vasp
Thu Sep 12, 2024 8:03 am
Regarding D2 and D3 corrections

Last post by support_vasp « Thu Sep 12, 2024 8:02 am
Replies: 1
by konda.physics@gmail.com » Sun Jun 01, 2014 5:04 pm

1 Replies

1564 Views

Last post by support_vasp
Thu Sep 12, 2024 8:02 am
What is the E_soc exactly mean in SOC output?

Last post by support_vasp « Thu Sep 12, 2024 8:02 am
Replies: 1
by pangr » Mon Nov 10, 2014 4:23 pm

1 Replies

1943 Views

Last post by support_vasp
Thu Sep 12, 2024 8:02 am
BSE absorption spectra

Last post by support_vasp « Thu Sep 12, 2024 8:02 am
Replies: 1
by 5-579 » Wed Jun 04, 2014 5:57 am

1 Replies

1371 Views

Last post by support_vasp
Thu Sep 12, 2024 8:02 am
Set ISMEAR = 1 or 0 for TiN TiC?

Last post by support_vasp « Thu Sep 12, 2024 8:02 am
Replies: 1
by jbliu » Tue Jun 03, 2014 1:16 am

1 Replies

1316 Views

Last post by support_vasp
Thu Sep 12, 2024 8:02 am
INCAR of F2 molecule

Last post by support_vasp « Thu Sep 12, 2024 8:01 am
Replies: 1
by nawwara » Mon Nov 18, 2013 4:35 pm

1 Replies

1255 Views

Last post by support_vasp
Thu Sep 12, 2024 8:01 am
Selective dispersion corrections on Au

Last post by support_vasp « Thu Sep 12, 2024 8:01 am
Replies: 1
by QuantumFist » Sun Jul 28, 2013 9:29 pm

1 Replies

1167 Views

Last post by support_vasp
Thu Sep 12, 2024 8:01 am
LDA+U

Last post by support_vasp « Thu Sep 12, 2024 8:01 am
Replies: 1
by zaz » Thu Feb 06, 2014 1:29 pm

1 Replies

1218 Views

Last post by support_vasp
Thu Sep 12, 2024 8:01 am
Convergence with dipole correction

Last post by support_vasp « Thu Sep 12, 2024 8:01 am
Replies: 1
by Yue-Wen Fang » Mon Jul 29, 2013 1:52 am

1 Replies

1295 Views

Last post by support_vasp
Thu Sep 12, 2024 8:01 am
coulomb energies

Last post by support_vasp « Thu Sep 12, 2024 8:01 am
Replies: 1
by Tonykuttan » Fri Dec 30, 2011 1:11 am

1 Replies

1265 Views

Last post by support_vasp
Thu Sep 12, 2024 8:01 am
scaled velocities in the CONTCAR file

Last post by support_vasp « Thu Sep 12, 2024 8:01 am
Replies: 1
by sammu09 » Mon Jul 29, 2013 9:44 pm

1 Replies

1180 Views

Last post by support_vasp
Thu Sep 12, 2024 8:01 am
Combine xml files to be read in VMD?

Last post by support_vasp « Thu Sep 12, 2024 8:00 am
Replies: 1
by jgsmi » Wed Sep 12, 2012 4:40 am

1 Replies

1451 Views

Last post by support_vasp
Thu Sep 12, 2024 8:00 am
INCAR of F2 molecule

Last post by support_vasp « Thu Sep 12, 2024 8:00 am
Replies: 1
by nawwara » Mon Nov 18, 2013 4:34 pm

1 Replies

1376 Views

Last post by support_vasp
Thu Sep 12, 2024 8:00 am
How vasp is projecting DOS?

Last post by support_vasp « Thu Sep 12, 2024 8:00 am
Replies: 1
by Kinga » Tue Sep 11, 2012 5:42 pm

1 Replies

1168 Views

Last post by support_vasp
Thu Sep 12, 2024 8:00 am
Reason for why high precision gives wrong band gap.

Last post by support_vasp « Thu Sep 12, 2024 8:00 am
Replies: 1
by shyam » Sat Jun 01, 2013 9:30 am

1 Replies

1217 Views

Last post by support_vasp
Thu Sep 12, 2024 8:00 am
The difference between Valence band top and fermi level in vasp

Last post by support_vasp « Thu Sep 12, 2024 8:00 am
Replies: 1
by zhangjinmt » Mon Apr 22, 2013 9:12 am

1 Replies

1355 Views

Last post by support_vasp
Thu Sep 12, 2024 8:00 am
total (ionic + electronic) macroscopic dielectric tensor using LEPSILON

Last post by support_vasp « Thu Sep 12, 2024 8:00 am
Replies: 1
by dhfphysics » Tue Jun 12, 2012 1:12 am

1 Replies

1573 Views

Last post by support_vasp
Thu Sep 12, 2024 8:00 am
Calculating Effective Correlation Energy?

Last post by support_vasp « Thu Sep 12, 2024 7:59 am
Replies: 1
by maryam » Fri Sep 07, 2012 2:32 pm

1 Replies

1134 Views

Last post by support_vasp
Thu Sep 12, 2024 7:59 am

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